RefChem:858301
TL;DR: RefChem:858301 (CAS 67859-49-8) is a chemical compound with molecular formula C14H18N2Na2O8Pd and molecular weight 493.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-[[2-[bis(carboxylatomethyl)amino]cyclohexyl]-(carboxylatomethyl)amino]acetate;palladium(2+)
Also Known As: Sodium palladium 1,2-cyclohexanediaminetetraacetate, Palladate(2-), ((N,N'-1,2-cyclohexanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, disodium, (OC-6-21)-, Palladate(2-), ((N,N'-1,2-cyclohexanediylbis(N-((carboxy-kappaO)methyl)glycinato-kappaN,kappaO))(4-))-, sodium (1:2), (OC-6-21)-, palladium(2+) sodium 2,2',2'',2'''-(cyclohexane-1,2-diyldinitrilo)tetraacetate(1:2:1), Palladate(2-), [[N,N'-1,2-cyclohexanediylbis[N-[(carboxy-.kappa.O)methyl]glycinato-.kappa.N,.kappa.O]](4-)]-, disodium, (OC-6-21)-
| Molecular Formula | C14H18N2Na2O8Pd |
|---|---|
| Molecular Weight | 493.99 g/mol |
| LogP | -12.09 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 493.98932 |
| Heavy Atoms | 27 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 67859-49-8 |
|---|---|
| SMILES | C1CCC(C(C1)N(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Pd+2] |
| InChIKey | WPMRYLHDKMNDEM-UHFFFAOYSA-J |
Product Overview
RefChem:858301 (CAS 67859-49-8), with molecular formula C14H18N2Na2O8Pd and molecular weight 493.99 g/mol. IUPAC: disodium;2-[[2-[bis(carboxylatomethyl)amino]cyclohexyl]-(carboxylatomethyl)amino]acetate;palladium(2+).
Chemical Property Profile of RefChem:858301
Property Insights of RefChem:858301
The XLogP value of -12.09 indicates that RefChem:858301 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:858301 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:858301 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:858301?
The CAS number of RefChem:858301 is 67859-49-8.
What is the molecular formula of RefChem:858301?
The molecular formula of RefChem:858301 is C14H18N2Na2O8Pd.
What is the molecular weight of RefChem:858301?
The molecular weight of RefChem:858301 is 493.99 g/mol.
Where can I buy RefChem:858301?
You can request a quote for RefChem:858301 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:858301?
Yes, KEHONG BIO provides custom synthesis services for RefChem:858301 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.